SCHEMBL18656221

SCHEMBL18656221

Cc1ccc(Oc2cc(OCCCC(=O)O)ccc2Cl)cc1

nearest known ligand 0.56

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
FFAR4 Q5NUL3 11/20 0.56
PPARG P37231 2/20 0.55
FFAR1 O14842 6/20 0.54
L3MBTL1 Q9Y468 1/20 0.54
TSHR P16473 1/20 0.52
SCN5A Q14524 2/20 0.46
CYP2C9 P11712 1/20 0.46
MCL1 Q07820 2/20 0.46
PPARA Q07869 1/20 0.46
CYP3A4 P08684 1/20 0.45
KCNH2 Q12809 1/20 0.45
CACNA1C Q13936 1/20 0.45

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL7827993 0.82 TSHR (0.71) FFAR4PPARGFFAR1L3MBTL1TSHR
SCHEMBL18656075 0.81 PPARD (0.44) PPARGFFAR1L3MBTL1MCL1PPARA
SCHEMBL7827991 0.80 MCL1 (0.69) FFAR4FFAR1MCL1
SCHEMBL6883728 0.80 L3MBTL1 (0.82) FFAR4PPARGFFAR1L3MBTL1TSHR
SCHEMBL29700092 0.78 FFAR4 (0.62) FFAR4FFAR1SCN5ACYP2C9
SCHEMBL116455 0.78 FFAR4 (0.62) FFAR4FFAR1SCN5ACYP2C9
SCHEMBL21533581 0.77 FFAR4 (0.58) FFAR4PPARGFFAR1L3MBTL1TSHR
SCHEMBL30888680 0.76 LMNA (0.54) FFAR4PPARGFFAR1L3MBTL1TSHR
SCHEMBL11428548 0.76 HTR2A (0.50) L3MBTL1CYP2C9KCNH2
SCHEMBL14570559 0.76 TSHR (0.62) FFAR4PPARGFFAR1L3MBTL1TSHR

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3144303-A1 6-SUBSTITUTED PHENOXYCHROMAN CARBOXYLIC ACID DERIVATIVES Array Biopharma, Inc. (US) 2017-03-22 EP disclosed